N-(3-methylbutyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(3-methylbutyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-isopentyl-benzamide CAS Name: N-(3-methylbutyl)-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(3-methylbutyl)benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-isoamyl-benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-19(2)11-12-24-23(27)21-9-6-10-22(17-21)30(28,29)26-15-13-25(14-16-26)18-20-7-4-3-5-8-20/h3-10,17,19H,11-16,18H2,1-2H3,(H,24,27)